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SMILES: C[C@H](NC(=O)N(C)C)c1ccc(OC2CN(C2)c2ccc(OC3CC3)cc2)cc1

InChI Key: InChIKey=GCEPDPUDGADINQ-INIZCTEOSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 101952   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Isoform 3 of Acetyl-CoA carboxylase 2 (ACC2.v2)


(Homo sapiens (Human))		BDBM101952
PNG
(US8530460, 1.32)
Show SMILES C[C@H](NC(=O)N(C)C)c1ccc(OC2CN(C2)c2ccc(OC3CC3)cc2)cc1 |r|
Show InChI InChI=1S/C23H29N3O3/c1-16(24-23(27)25(2)3)17-4-8-19(9-5-17)29-22-14-26(15-22)18-6-10-20(11-7-18)28-21-12-13-21/h4-11,16,21-22H,12-15H2,1-3H3,(H,24,27)/t16-/m0/s1
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Similars
US Patent
n/an/a 190n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Enzyme assay using human acetyl-CoA carboxylase 2 (ACC).

US Patent US8530460 (2013)


BindingDB Entry DOI: 10.7270/Q2X34W3N
More data for this
Ligand-Target Pair